SCHEMBL29313918

SCHEMBL29313918

CN(C(=O)Oc1c(C(F)(F)F)cc(C(F)(F)F)nc1-n1ccn(CC(O)N(C)C)c1=S)c1ccc(F)cc1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
POLQ O75417 2/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29313920 0.90 POLQ (0.33) POLQ
SCHEMBL29313871 0.87
SCHEMBL29313922 0.85 POLQ (0.34) POLQ
SCHEMBL29313860 0.80 POLQ (0.34) POLQ
SCHEMBL29313925 0.76 POLQ (0.32) POLQ
SCHEMBL29314313 0.71 NPSR1 (0.31)
SCHEMBL29313704 0.68 POLQ (0.39) POLQ
SCHEMBL29313948 0.66 POLQ (0.35) POLQ
SCHEMBL29314384 0.64 POLQ (0.52) POLQ
SCHEMBL30847596 0.63 POLQ (0.50) POLQ

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024147972-A2 DNA POLYMERASE THETA INHIBITORS CONTAINING NON-SATURATED 5-MEMBERED HETEROCYCLIC RINGS AND USE THEREOF THOMAS JEFFERSON UNIVERSITY (US) 2024-07-11 WO disclosed